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#54;BENZYL-(3,4,6-TRI-O-BENZYL-2-DEOXY-2-TRICHLOROACETAMIDO-BETA-D-GALACTOPYRANOSYL)-(1->2)-(3-O-ACETYL-4-O-BENZYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-(3,4-DI-O-BE

View entire compound with spectra: 1 NMR

#54;BENZYL-(3,4,6-TRI-O-BENZYL-2-DEOXY-2-TRICHLOROACETAMIDO-BETA-D-GALACTOPYRANOSYL)-(1->2)-(3-O-ACETYL-4-O-BENZYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-(3,4-DI-O-BE
SpectraBase Compound ID k7kIMJS1vE
InChI InChI=1S/C94H100Cl3NO21/c1-5-51-103-90-85(110-59-72-47-29-13-30-48-72)81(109-58-71-45-27-12-28-46-71)83(84(117-90)88(100)111-60-73-49-31-14-32-50-73)116-91-86(80(108-57-70-43-25-11-26-44-70)76(62(2)112-91)104-53-66-35-17-7-18-36-66)119-92-87(82(114-64(4)99)77(63(3)113-92)105-54-67-37-19-8-20-38-67)118-89-75(98-93(101)94(95,96)97)79(107-56-69-41-23-10-24-42-69)78(106-55-68-39-21-9-22-40-68)74(115-89)61-102-52-65-33-15-6-16-34-65/h5-50,62-63,74-87,89-92H,1,51-61H2,2-4H3,(H,98,101)/t62-,63-,74-,75-,76-,77-,78+,79-,80+,81-,82+,83+,84-,85+,86+,87+,89+,90+,91-,92-/m0/s1
InChIKey CZUDMIWSYOVBSS-KFEXXTMUSA-N
Mol Weight 1686.2 g/mol
Molecular Formula C94H100Cl3NO21
Exact Mass 1683.585342 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8qPq5Wdq1wj
Name #54;BENZYL-(3,4,6-TRI-O-BENZYL-2-DEOXY-2-TRICHLOROACETAMIDO-BETA-D-GALACTOPYRANOSYL)-(1->2)-(3-O-ACETYL-4-O-BENZYL-ALPHA-L-RHAMNOPYRANOSYL)-(1->2)-(3,4-DI-O-BE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C94H100Cl3NO21
InChI InChI=1S/C94H100Cl3NO21/c1-5-51-103-90-85(110-59-72-47-29-13-30-48-72)81(109-58-71-45-27-12-28-46-71)83(84(117-90)88(100)111-60-73-49-31-14-32-50-73)116-91-86(80(108-57-70-43-25-11-26-44-70)76(62(2)112-91)104-53-66-35-17-7-18-36-66)119-92-87(82(114-64(4)99)77(63(3)113-92)105-54-67-37-19-8-20-38-67)118-89-75(98-93(101)94(95,96)97)79(107-56-69-41-23-10-24-42-69)78(106-55-68-39-21-9-22-40-68)74(115-89)61-102-52-65-33-15-6-16-34-65/h5-50,62-63,74-87,89-92H,1,51-61H2,2-4H3,(H,98,101)/t62-,63-,74-,75-,76-,77-,78+,79-,80+,81-,82+,83+,84-,85+,86+,87+,89+,90+,91-,92-/m0/s1
InChIKey CZUDMIWSYOVBSS-KFEXXTMUSA-N
Literature Reference Author P.CHASSAGNE,C.FONTANA,C.GUERREIRO,C.GAUTHIER,A.PHALIPON,G.WI DMALM,L.A.MULARD
Literature Reference Citation EUR.J.ORG.CHEM.,2013,4085(2013)
Literature Reference DOI 10.1002/ejoc.201300180
Molecular Weight 1686.181 g/mol
Solvent CDCl3
Source File Reference UWBT19021